| SpectraBase Spectrum ID |
NPbCnYN6Z5 |
| Name |
Butyl 4-[({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}carbothioyl)amino]benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.141261755 u |
| Formula |
C18H22N4O3S |
| InChI |
InChI=1S/C18H22N4O3S/c1-3-5-10-25-17(24)13-6-8-15(9-7-13)20-18(26)21-16(23)14-11-19-22(4-2)12-14/h6-9,11-12H,3-5,10H2,1-2H3,(H2,20,21,23,26) |
| InChIKey |
VAHARSNZNRZXHH-UHFFFAOYSA-N |
| Molecular Weight |
374.459 g/mol |
| SMILES |
N(C(C1=CN(CC)N=C1)=O)C(NC=1C=CC(C(=O)OCCCC)=CC1)=S |
![butyl 4-[({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}carbothioyl)amino]benzoate](/api/spectrum/NPbCnYN6Z5/structure.png?h=300&w=458 "butyl 4-[({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}carbothioyl)amino]benzoate")
